SCHEMBL6288849

SCHEMBL6288849

CC1C=C(c2ccccc2)OC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 7/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
KDM4E B2RXH2 3/20 0.39
POLB P06746 2/20 0.39
PKM P14618 2/20 0.39
ALOX12 P18054 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.37
MAPK1 P28482 1/20 0.37
LMNA P02545 4/20 0.37
PTGS2 P35354 1/20 0.34
HPGD P15428 2/20 0.34
GRM2 Q14416 1/20 0.34
HTT P42858 3/20 0.33
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5936335 1.00 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPTMEN1KMT2A
SCHEMBL11192910 0.81 GRM2 (0.39) ALDH1A1MAPTKDM4EMAPK1GRM2
SCHEMBL6288320 0.73 MAPT (0.43) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL27771891 0.72 ALDH1A1 (0.36) ALDH1A1L3MBTL1MAPTMEN1KMT2A
SCHEMBL5936329 0.64
SCHEMBL5936336 0.64
SCHEMBL24425855 0.64 SMN1; SMN2 (0.41) ALDH1A1L3MBTL1MAPTMEN1KMT2A
SCHEMBL11215643 0.63
SCHEMBL4014173 0.61 BACE1 (0.39) MAPTMEN1KMT2APOLBLMNA
SCHEMBL28484432 0.61 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPTMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2940781-A1 LOADED BODY AND PHOTOELECTRIC CONVERSION ELEMENT Adeka Corporation (JP) 2015-11-04 EP disclosed
US-6956055-B2 Substituted γ-lactone compounds as NMDA-antagonists GRUNENTHAL GMBH (DE) 2005-10-18 US disclosed
US-4374249-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1983-02-15 US disclosed